disodium 2-[1-(phenylmethyl)-5-(phosphonatomethoxy)indol-3-yl]ethanamide

Systemtic Name: disodium 2-[1-(phenylmethyl)-5-(phosphonatomethoxy)indol-3-yl]ethanamide Openeye Name: disodium 2-[1-benzyl-5-(phosphonatomethoxy)indol-3-yl]acetamide CAS Name: disodium 2-[1-(phenylmethyl)-5-(phosphonatomethoxy)-3-indolyl]acetamide IUPAC Name: disodium 2-[1-benzyl-5-(phosphonatomethoxy)indol-3-yl]acetamide Traditional Name: disodium 2-[1-benzyl-5-(phosphonatomethoxy)indol-3-yl]acetamide Formula: C18H17N2Na2O5P MolecularWeight: 418.291281

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C3=C2C=CC(=C3)OCP(=O)([O-])[O-])CC(=O)N.[Na+].[Na+]

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C3=C2C=CC(=C3)OCP(=O)([O-])[O-])CC(=O)N.[Na+].[Na+]

InChI

InChI=1S/C18H19N2O5P.2Na/c19-18(21)8-14-11-20(10-13-4-2-1-3-5-13)17-7-6-15(9-16(14)17)25-12-26(22,23)24;;/h1-7,9,11H,8,10,12H2,(H2,19,21)(H2,22,23,24);;/q;2*+1/p-2